N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide

C17H31N3O3 — CID 134051259

IUPACN-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
SMILESCCC(C)(C)NC(=O)CN1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C17H31N3O3/c1-4-17(2,3)18-15(21)13-19-7-5-6-14(12-19)16(22)20-8-10-23-11-9-20/h14H,4-13H2,1-3H3,(H,18,21)
InChIKeyMXEYLFAOTRHXKD-UHFFFAOYSA-N
MW325.45 g/mol
LogP0.86
Rot. Bonds5

About N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide

N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide (PubChem CID 134051259) has the molecular formula C17H31N3O3 and a molecular weight of 325.45 g/mol. Its IUPAC name is N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
PubChem CID134051259
Molecular FormulaC17H31N3O3
Molecular Weight325.45 g/mol
Exact Mass325.24
IUPAC NameN-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
SMILESCCC(C)(C)NC(=O)CN1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C17H31N3O3/c1-4-17(2,3)18-15(21)13-19-7-5-6-14(12-19)16(22)20-8-10-23-11-9-20/h14H,4-13H2,1-3H3,(H,18,21)
InChIKeyMXEYLFAOTRHXKD-UHFFFAOYSA-N
XLogP0.86
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.45
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-hydroxypiperidin-1-yl)-N-(2-methylbutan-2-yl)acetamide
CID 60672191
N-(2-methylcyclohexyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
CID 134051309
N-(2-ethylphenyl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
CID 55501528
N-cyclohexyl-2-[3-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide
CID 165434073
1-(4-methylpiperidin-1-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone
CID 134051301
[(3R)-1-decylpiperidin-3-yl]-morpholin-4-ylmethanone
CID 125473797
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
CID 84569046
2-(3-hydroxypyrrolidin-1-yl)-N-(2-methylbutan-2-yl)acetamide
CID 62918018
N-(2-methylbutan-2-yl)-2-[4-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 30989737
N-[(3-fluoro-4-methylphenyl)methyl]-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
CID 134051297
[(3R)-1-methylpiperidin-3-yl]-morpholin-4-ylmethanone
CID 95907299
methyl 1-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]piperidine-4-carboxylate
CID 60672509

Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide (CID 134051259) is N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide is CCC(C)(C)NC(=O)CN1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The InChIKey is MXEYLFAOTRHXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3O3/c1-4-17(2,3)18-15(21)13-19-7-5-6-14(12-19)16(22)20-8-10-23-11-9-20/h14H,4-13H2,1-3H3,(H,18,21).
What are the key properties of N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide has a molecular weight of 325.45 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutan-2-yl)-2-[3-(morpholine-4-carbonyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 134051259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).